3-methyl-2-tridecoxycarbonyl-hexadecane-1,1,1-tricarboxylic acid

Systemtic Name: 3-methyl-2-tridecoxycarbonyl-hexadecane-1,1,1-tricarboxylic acid Openeye Name: 3-methyl-2-tridecoxycarbonyl-hexadecane-1,1,1-tricarboxylic acid CAS Name: 3-methyl-2-[oxo(tridecoxy)methyl]hexadecane-1,1,1-tricarboxylic acid IUPAC Name: 3-methyl-2-tridecoxycarbonylhexadecane-1,1,1-tricarboxylic acid Traditional Name: 3-methyl-2-tridecoxycarbonyl-hexadecane-1,1,1-tricarboxylic acid Formula: C34H62O8 MolecularWeight: 598.85128

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Descriptors Computed from Structure

Canonical SMILES:

CCCCCCCCCCCCCC(C)C(C(=O)OCCCCCCCCCCCCC)C(C(=O)O)(C(=O)O)C(=O)O

Isomeric SMILES

CCCCCCCCCCCCCC(C)C(C(=O)OCCCCCCCCCCCCC)C(C(=O)O)(C(=O)O)C(=O)O

InChI

InChI=1S/C34H62O8/c1-4-6-8-10-12-14-16-18-20-22-24-26-28(3)29(34(31(36)37,32(38)39)33(40)41)30(35)42-27-25-23-21-19-17-15-13-11-9-7-5-2/h28-29H,4-27H2,1-3H3,(H,36,37)(H,38,39)(H,40,41)